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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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81243 49854500 2 OF2N2C10H11 AB2C2D10E11 -245.17 2.19 -9.09 -0.44 0
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81244 49854501 1 O2F4N4C19H20 A2B4C4D19E20 -226.45 4.98 -8.92 -0.66 0
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81245 49854502 1 O2N4F5H17C18 A2B4C5D17E18 -281.59 1.61 -9.09 -0.84 0
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81246 49854503 1 O3N4F5H17C19 A3B4C5D17E19 -316.28 4.39 -9.27 -1.21 0
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81247 49854504 1 O3N4F5H17C19 A3B4C5D17E19 -316.7 2.88 -9.27 -1.16 0
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81248 49854506 3 NOH5C6 ABC5D6 0.77 4.91 -8.84 -1.31 0
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81249 49854507 1 N2O3H18C21 A2B3C18D21 -6.03 5.28 -8.47 -1.13 0
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81250 49854508 1 SN3O5C17H27 AB3C5D17E27 -169.04 4.65 -8.88 -0.4 0
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81251 49854509 1 SN3O6C17H25 AB3C6D17E25 -139.11 5.21 -9.68 -0.65 0
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81252 49854511 1 SN4O5C25H30 AB4C5D25E30 -112.03 5.19 -9.35 -0.84 0
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81253 49854512 1 SN3O6C24H33 AB3C6D24E33 -179.59 10.72 -9.1 -0.62 0
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81254 49854513 1 SN4O5C24H28 AB4C5D24E28 -104.25 2.42 -9.46 -1.01 0
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81255 49854514 1 O3N4H16C22 A3B4C16D22 -25.75 4.58 -9.56 -1.41 0
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81256 49854515 1 O3N5H23C25 A3B5C23D25 -19.87 3.85 -9.08 -1.5 0
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81257 49854517 1 O3N5C27H35 A3B5C27D35 -70.38 7.29 -8.53 -0.67 0
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81258 49854518 1 N6O6C25H28 A6B6C25D28 -139.4 1.95 -9.12 -0.99 0
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81259 49854519 1 ON2C18H26 AB2C18D26 -7.33 1.31 -8.24 0.3 0
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81260 49854520 1 ON2C18H22 AB2C18D22 60.7 2.08 -8.34 0.2 0
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81261 49854521 1 SN2O3C16H22 AB2C3D16E22 -79.05 6.66 -8.54 -0.05 0
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81262 49854522 1 SN2C15H20 AB2C15D20 45.84 1.09 -8.61 0.08 0
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81263 49854523 1 ON2C19H26 AB2C19D26 19.43 1.35 -8.31 0.28 0
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81264 49854524 1 SN3O5C18H23 AB3C5D18E23 -176.89 3.8 -8.95 -0.2 0
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81265 49854525 1 O4N5C19H21 A4B5C19D21 -62.43 2.46 -9.33 -0.57 0
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81266 49854526 1 FO3N4C19H21 AB3C4D19E21 -129.03 6.16 -9.12 -0.68 0
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81267 49854527 1 O3N4C19H22 A3B4C19D22 -73.44 8.07 -9.13 -0.44 0